Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4161674 | 0.79 | SIGMAR1 (0.52) | RAB9ACA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL14577388 | 0.78 | RAB9A (0.50) | RAB9ACA12CA1CA2CA9 | |
| SCHEMBL11413916 | 0.77 | SIGMAR1 (0.48) | RAB9ACA12CA1CA2CA9 | |
| SCHEMBL31554541 | 0.77 | SIGMAR1 (0.48) | RAB9ACA12CA1CA2CA9 | |
| Iodide SCHEMBL11173333 | 0.77 | RAB9A (0.45) | RAB9AGAASIGMAR1SMN1; SMN2NPC1 | |
| Iodide SCHEMBL10827472 | 0.76 | NPC1 (0.55) | RAB9AGAAHPGDSMN1; SMN2NPC1 | |
| SCHEMBL6371005 | 0.75 | RAB9A (0.75) | RAB9ACA12CA1CA2CA9 | |
| SCHEMBL6117229 | 0.75 | RAB9A (0.61) | RAB9ACA12CA1CA2CA9 | |
| Iodide SCHEMBL11161499 | 0.75 | LMNA (0.46) | RAB9AGAAHPGDSMN1; SMN2NPC1 | |
| SCHEMBL16893363 | 0.74 | RAB9A (0.45) | RAB9ACA12CA1CA2CA9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4414211-A | HYPOGLYCEMIC/- | MCNEILAB, INC. (US) | 1983-11-08 | — | — | US | disclosed |